Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 2/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.42 |
| ▸ | DPP4 | P27487 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20031675 | 0.87 | NPC1 (0.44) | CHRM2CHRM4CHRM1DPP4NPC1 | |
| SCHEMBL13188552 | 0.83 | NPC1 (0.53) | CHRM2CHRM4CHRM1DPP4NPC1 | |
| SCHEMBL24157448 | 0.82 | DPP4 (0.44) | CHRM2CHRM4CHRM1DPP4NPC1 | |
| SCHEMBL12765238 | 0.82 | DPP4 (0.44) | CHRM2CHRM4CHRM1DPP4NPC1 | |
| SCHEMBL12765239 | 0.82 | DPP4 (0.44) | CHRM2CHRM4CHRM1DPP4NPC1 | |
| SCHEMBL9221110 | 0.80 | CHRNB2 (0.50) | CHRM2CHRM4CHRM1DPP4NPC1 | |
| SCHEMBL9216541 | 0.80 | CHRNB2 (0.50) | CHRM2CHRM4CHRM1DPP4NPC1 | |
| SCHEMBL11892683 | 0.80 | CHRNB2 (0.50) | CHRM2CHRM4CHRM1DPP4NPC1 | |
| SCHEMBL15985440 | 0.80 | CHRNB2 (0.40) | NPC1CYP3A4MEN1POLBMAPT | |
| SCHEMBL20232927 | 0.79 | NPC1 (0.67) | CHRM2CHRM4CHRM1NPC1MEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010100144-A1 | FUSED BICYCLIC COMPOUNDS AS INHIBITORS FOR PI3 KINASE | MERCK SERONO S.A. (CH) | 2010-09-10 | — | — | WO | disclosed |